SCHEMBL1934653

SCHEMBL1934653

Brc1cn2ccnc2c(C2CC2)n1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.44
NUDT1 P36639 1/20 0.32
SYK P43405 1/20 0.31
TRIM24 O15164 1/20 0.30
CCNE1 P24864 1/20 0.30
CDK2 P24941 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL103894 0.74 HTR2C (0.53) HTR2CL3MBTL1NUDT1
SCHEMBL17375448 0.73
SCHEMBL12584607 0.73 HTR2C (0.46) HTR2CL3MBTL1NUDT1
SCHEMBL1934008 0.73 HTR2C (0.46) HTR2CL3MBTL1SYKTRIM24
SCHEMBL24386932 0.72 HTR2C (0.50) HTR2CL3MBTL1NUDT1
SCHEMBL5477688 0.72 NUDT1 (0.55) HTR2CL3MBTL1NUDT1
SCHEMBL9970925 0.72 HTR2C (0.50) HTR2CL3MBTL1NUDT1
SCHEMBL19865160 0.72 L3MBTL1 (0.53) HTR2CL3MBTL1NUDT1SYK
SCHEMBL1934651 0.71 HTR2C (0.50) HTR2CL3MBTL1NUDT1
SCHEMBL19616550 0.70 HTR2C (0.43) HTR2CL3MBTL1TRIM24CCNE1CDK2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2509602-A1 PYRAZOLOPYRIMIDINES AND RELATED HETEROCYCLES AS CK2 INHIBITORS Cylene Pharmaceuticals, Inc. (US) 2012-10-17 EP disclosed
WO-2011068667-A1 PYRAZOLOPYRIMIDINES AND RELATED HETEROCYCLES AS CK2 INHIBITORS CYLENE PHARMACEUTICALS, INC. (US) 2011-06-09 WO disclosed